Superconducting and correlated phases of an effective Hubbard model on the BCC lattice

Abstract

We investigate the electronic phases of an effective Hubbard model on the body-centered-cubic lattice, motivated by alkali-doped fulleride molecular solids. The model incorporates renormalized on-site interactions and an effective inverted Hund's coupling originating from electron-phonon interactions. To access complementary interaction regimes, we employ two theoretical approaches. In the intermediate-coupling regime, the on-site repulsive interaction is approximated by a long-range interaction in momentum space, yielding an exactly solvable Hatsugai-Kohmoto model supplemented by a BCS-type pairing term. Within this framework, we analyze the superconducting instability and demonstrate a first-order normal-superconducting phase transition, characterized by a discontinuous jump of the order parameter. In the strong-coupling regime, where pairing fluctuations are suppressed, we apply the spin rotationally invariant slave-boson formalism to map out the temperature-interaction phase diagram. This analysis reveals first-order transitions between a Fermi-liquid phase, an antiferromagnetic phase, and a Mott insulating phase, with a narrow intermediate region where all three phases compete. The resulting phase diagram captures the interplay of itinerancy, magnetic order, and Mott localization in three dimensions and provides a unified perspective on superconducting and correlation-driven phenomena in fulleride-inspired lattice systems.